Detailed information for compound 1457493

Basic information

Technical information
  • TDR Targets ID: 1457493
  • Name: N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]p henyl]-2,6-dimethoxybenzamide
  • MW: 442.488 | Formula: C21H22N4O5S
  • H donors: 2 H acceptors: 5 LogP: 2.64 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cccc(c1C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1cc(C)nc(n1)C)OC
  • InChi: 1S/C21H22N4O5S/c1-13-12-19(23-14(2)22-13)25-31(27,28)16-10-8-15(9-11-16)24-21(26)20-17(29-3)6-5-7-18(20)30-4/h5-12H,1-4H3,(H,24,26)(H,22,23,25)
  • InChiKey: QJPBEYAQFWMEQT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]-2,6-dimethoxy-benzamide
  • N-[4-[(2,6-dimethyl-4-pyrimidinyl)sulfamoyl]phenyl]-2,6-dimethoxybenzamide
  • ZINC00790564
  • BAS 05129226
  • IVK/8122113
  • MLS000075910
  • N-[4-(2,6-Dimethyl-pyrimidin-4-ylsulfamoyl)-phenyl]-2,6-dimethoxy-benzamide
  • SMR000013168

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens arachidonate 15-lipoxygenase Starlite/ChEMBL No references
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens bromodomain adjacent to zinc finger domain, 2B Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Conserved hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum ko:K01549 ATP synthase [EC3.6.3.14], putative Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma mansoni bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Brugia malayi Bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus granulosus bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum expressed protein Get druggable targets OG5_131570 All targets in OG5_131570
Schistosoma japonicum Cleft lip and palate transmembrane protein 1-like protein, putative Get druggable targets OG5_131570 All targets in OG5_131570
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus granulosus arachidonate 5 lipoxygenase arachidonate 15-lipoxygenase 662 aa 590 aa 23.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.0027 0.0623 0.3801
Schistosoma mansoni lipoxygenase 0.0024 0.0507 0.0406
Echinococcus multilocularis RUN 0.0024 0.0507 0.0406
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0064 0.2008 0.2117
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0026 0.0603 0.0546
Schistosoma mansoni hypothetical protein 0.0018 0.0308 0.0113
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0043 0.1239 0.1481
Echinococcus granulosus tar DNA binding protein 0.0199 0.7038 1
Schistosoma mansoni hypothetical protein 0.0138 0.4783 0.6686
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.1242 1
Brugia malayi TAR-binding protein 0.0199 0.7038 0.8108
Loa Loa (eye worm) RNA binding protein 0.0199 0.7038 0.8147
Schistosoma mansoni rab6-interacting 0.0024 0.0507 0.0406
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0387 0.0229
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.0027 0.0623 0.0623
Loa Loa (eye worm) hypothetical protein 0.0052 0.1542 0.1737
Echinococcus multilocularis BC026374 protein (S09 family) 0.0026 0.0603 0.0546
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.1242 0.1242
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0027 0.0635 0.0593
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0021 0.0387 0.0229
Mycobacterium leprae Probable polyketide synthase Pks1 0.0027 0.0623 0.3801
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.1242 0.1486
Loa Loa (eye worm) transcription factor SMAD2 0.0241 0.8627 1
Echinococcus granulosus GPCR family 2 0.0064 0.2008 0.2611
Onchocerca volvulus 0.0043 0.1242 0.1168
Echinococcus granulosus RUN 0.0024 0.0507 0.0406
Brugia malayi beta-lactamase family protein 0.0043 0.1242 0.1204
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.1242 1
Mycobacterium ulcerans thioesterase TesA 0.0021 0.0406 0.1631
Brugia malayi MH2 domain containing protein 0.0241 0.8627 1
Loa Loa (eye worm) carboxylesterase 0.0026 0.0603 0.0642
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0193 0.6837 1
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.0027 0.0623 0.0623
Brugia malayi hypothetical protein 0.0024 0.0507 0.0329
Mycobacterium ulcerans lipase LipD 0.0043 0.1242 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.0021 0.0387 0.0229
Plasmodium falciparum LCCL domain-containing protein 0.0024 0.0507 0.5
Onchocerca volvulus 0.0026 0.0603 0.0159
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.1242 0.1387
Mycobacterium ulcerans Type I modular polyketide synthase 0.0025 0.0564 0.3212
Brugia malayi Carboxylesterase family protein 0.0026 0.0603 0.0443
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.002 0.0379 0.1359
Loa Loa (eye worm) MH2 domain-containing protein 0.0241 0.8627 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0064 0.2008 0.2611
Mycobacterium ulcerans hypothetical protein 0.0043 0.1242 1
Trichomonas vaginalis esterase, putative 0.0043 0.1242 1
Echinococcus granulosus Polycystic kidney disease protein 0.0024 0.0507 0.0406
Loa Loa (eye worm) Smad1 0.0016 0.0231 0.0208
Loa Loa (eye worm) hypothetical protein 0.0026 0.0603 0.0642
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.1242 1
Loa Loa (eye worm) hypothetical protein 0.0193 0.6837 0.7912
Echinococcus granulosus neuroligin 0.0026 0.0603 0.0546
Onchocerca volvulus 0.0026 0.0603 0.0159
Schistosoma mansoni bromodomain containing protein 0.0076 0.2473 0.3294
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0025 0.0564 0.0564
Echinococcus granulosus zinc finger protein 0.0024 0.0501 0.0396
Echinococcus multilocularis tar DNA binding protein 0.0199 0.7038 1
Onchocerca volvulus 0.0024 0.0507 0.0008
Mycobacterium leprae Probable lipase LipE 0.0043 0.1242 1
Brugia malayi Carboxylesterase family protein 0.0156 0.545 0.6217
Echinococcus multilocularis acetylcholinesterase 0.0156 0.545 0.7667
Mycobacterium tuberculosis Probable thioesterase TesA 0.0021 0.0406 0.0406
Brugia malayi Carboxylesterase family protein 0.0026 0.0603 0.0443
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0064 0.2008 0.2611
Loa Loa (eye worm) hypothetical protein 0.0026 0.0603 0.0642
Schistosoma mansoni loxhd1 0.0024 0.0507 0.0406
Schistosoma mansoni rab6-interacting 0.0024 0.0507 0.0406
Brugia malayi Doublecortin family protein 0.0024 0.0507 0.0329
Echinococcus multilocularis zinc finger protein 0.0024 0.0501 0.0396
Loa Loa (eye worm) hypothetical protein 0.0024 0.0507 0.053
Schistosoma mansoni polycystin 1-related 0.0024 0.0507 0.0406
Schistosoma mansoni tar DNA-binding protein 0.0199 0.7038 1
Brugia malayi RNA binding protein 0.0199 0.7038 0.8108
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.1242 0.1242
Brugia malayi hypothetical protein 0.0024 0.0507 0.0329
Mycobacterium ulcerans Type I modular polyketide synthase 0.0025 0.0564 0.3212
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.1242 1
Brugia malayi beta-lactamase 0.0043 0.1242 0.1204
Mycobacterium tuberculosis Conserved protein 0.0043 0.1242 0.1242
Echinococcus granulosus acetylcholinesterase 0.0156 0.545 0.7667
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0027 0.0623 0.3801
Loa Loa (eye worm) PHD-finger family protein 0.0025 0.0548 0.0578
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0026 0.0603 0.0603
Onchocerca volvulus Fatty acid synthase homolog 0.0046 0.1324 0.1298
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0067 0.2109 0.2759
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.1242 0.1204
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.1242 0.1242
Loa Loa (eye worm) beta-lactamase 0.0043 0.1242 0.1387
Loa Loa (eye worm) hypothetical protein 0.0043 0.1242 0.1387
Onchocerca volvulus 0.0026 0.0603 0.0159
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.0027 0.0623 0.3801
Echinococcus multilocularis GPCR, family 2 0.0064 0.2008 0.2611
Loa Loa (eye worm) hypothetical protein 0.0043 0.1242 0.1387
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.0025 0.0564 0.3212
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0026 0.0603 0.0546
Loa Loa (eye worm) TAR-binding protein 0.0199 0.7038 0.8147
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.002 0.0379 0.1359
Schistosoma mansoni hypothetical protein 0.0024 0.0507 0.0406
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0025 0.0564 0.3212
Brugia malayi Carboxylesterase family protein 0.0026 0.0603 0.0443
Leishmania major hypothetical protein, conserved 0.0043 0.1242 1
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0156 0.545 0.7667
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.0014 0.0155 0.0155
Mycobacterium ulcerans thioesterase 0.0021 0.0406 0.1631
Echinococcus multilocularis lipoxygenase domain containing protein 0.0024 0.0507 0.0406
Mycobacterium ulcerans polyketide synthase 0.0025 0.0564 0.3212
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0026 0.0603 0.0603
Mycobacterium tuberculosis Polyketide synthase Pks12 0.0027 0.0623 0.0623
Loa Loa (eye worm) hypothetical protein 0.0026 0.0603 0.0642
Mycobacterium tuberculosis Conserved protein 0.0043 0.1242 0.1242
Loa Loa (eye worm) hypothetical protein 0.0156 0.545 0.6295
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0064 0.2008 0.2611
Toxoplasma gondii type I fatty acid synthase, putative 0.0018 0.0291 0.1706
Schistosoma mansoni tar DNA-binding protein 0.0199 0.7038 1
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.1242 1
Schistosoma mansoni hypothetical protein 0.0064 0.2008 0.2611
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0021 0.0387 0.0229
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0021 0.0387 0.0229
Schistosoma mansoni lipoxygenase 0.0067 0.2109 0.2759
Echinococcus granulosus histone lysine methyltransferase setb 0.0021 0.0387 0.0229
Mycobacterium tuberculosis Polyketide synthase Pks13 0.0038 0.1033 0.1033
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.1242 0.1242
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0202 0.7174 0.8305
Echinococcus granulosus BC026374 protein S09 family 0.0026 0.0603 0.0546
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.0018 0.0297 0.0297
Echinococcus multilocularis lipoxygenase domain containing protein 0.0024 0.0507 0.0406
Brugia malayi beta-lactamase family protein 0.0043 0.1242 0.1204
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.0021 0.0406 0.1631
Loa Loa (eye worm) hypothetical protein 0.0026 0.0603 0.0642
Mycobacterium ulcerans polyketide synthase Pks13 0.0038 0.1033 0.7902
Loa Loa (eye worm) MH1 domain-containing protein 0.0016 0.0231 0.0208
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0026 0.0603 0.0546
Brugia malayi latrophilin 2 splice variant baaae 0.0138 0.4783 0.5421
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0072 0.2312 0.3057
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.0025 0.0564 0.3212
Loa Loa (eye worm) hypothetical protein 0.0024 0.0507 0.053
Loa Loa (eye worm) doublecortin family protein 0.0024 0.0507 0.053
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.1242 1
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0024 0.0502 0.0502
Loa Loa (eye worm) hypothetical protein 0.0043 0.1242 0.1387
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0072 0.2312 0.3057
Loa Loa (eye worm) hypothetical protein 0.0043 0.1208 0.1348
Echinococcus multilocularis para nitrobenzyl esterase 0.0026 0.0603 0.0546
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.1242 0.1486
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.0027 0.0623 0.3801
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.0016 0.0231 0.1184
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.1242 0.1242
Echinococcus multilocularis neuroligin 0.0026 0.0603 0.0546
Brugia malayi Calcitonin receptor-like protein seb-1 0.0202 0.7174 0.8269
Echinococcus granulosus lipoxygenase domain containing protein 0.0024 0.0507 0.0406
Loa Loa (eye worm) hypothetical protein 0.0021 0.0387 0.039
Schistosoma mansoni zinc finger protein 0.0024 0.0501 0.0396
Mycobacterium ulcerans carboxylesterase, LipT 0.0026 0.0603 0.3597
Echinococcus multilocularis carboxylesterase 5A 0.0156 0.545 0.7667
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0048 0.1412 0.1407
Mycobacterium ulcerans beta-lactamase 0.0043 0.1242 1
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0024 0.0502 0.0524
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.0038 0.1033 0.1033
Loa Loa (eye worm) hypothetical protein 0.0026 0.0603 0.0642
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.1242 0.1242
Echinococcus granulosus carboxylesterase 5A 0.0156 0.545 0.7667
Loa Loa (eye worm) acetylcholinesterase 1 0.0156 0.545 0.6295
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.002 0.0379 0.1359
Schistosoma mansoni hypothetical protein 0.0064 0.2008 0.2611
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0202 0.7174 0.8269
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0043 0.1239 0.1481
Toxoplasma gondii type I fatty acid synthase, putative 0.0027 0.0623 0.46
Brugia malayi Bromodomain containing protein 0.0091 0.3002 0.3301
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0025 0.0564 0.0564
Schistosoma mansoni acetylcholinesterase 0.0026 0.0603 0.0546
Loa Loa (eye worm) carboxylesterase 0.0156 0.545 0.6295
Schistosoma mansoni neuroligin 3 (S09 family) 0.0026 0.0603 0.0546
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.1242 0.1486
Schistosoma mansoni tar DNA-binding protein 0.0199 0.7038 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0021 0.0387 0.0229
Mycobacterium leprae conserved hypothetical protein 0.0043 0.1242 1
Schistosoma mansoni tar DNA-binding protein 0.0199 0.7038 1
Loa Loa (eye worm) hypothetical protein 0.0064 0.2008 0.2281
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0025 0.0564 0.0397
Loa Loa (eye worm) hypothetical protein 0.0043 0.1242 0.1387
Loa Loa (eye worm) hypothetical protein 0.0014 0.0148 0.0111
Schistosoma mansoni gliotactin 0.0026 0.0603 0.0546
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.1242 0.1242
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0026 0.0603 0.0546
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0064 0.2008 0.2611
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0067 0.2109 0.2759
Schistosoma mansoni zinc finger protein 0.0018 0.0308 0.0113
Echinococcus multilocularis Polycystic kidney disease protein 0.0024 0.0507 0.0406
Onchocerca volvulus 0.0044 0.1266 0.1205
Schistosoma mansoni BC026374 protein (S09 family) 0.0026 0.0603 0.0546
Echinococcus granulosus acetylcholinesterase 0.0156 0.545 0.7667
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0199 0.7038 0.8147
Onchocerca volvulus 0.0024 0.0507 0.0008
Brugia malayi hypothetical protein 0.0026 0.0603 0.0443
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0027 0.0635 0.0593
Toxoplasma gondii ABC1 family protein 0.0043 0.1242 1
Echinococcus granulosus para nitrobenzyl esterase 0.0026 0.0603 0.0546
Brugia malayi Latrophilin receptor protein 2 0.0064 0.2008 0.2117
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0387 0.0229
Brugia malayi Bromodomain containing protein 0.0046 0.1346 0.1328
Loa Loa (eye worm) hypothetical protein 0.0026 0.0603 0.0642
Loa Loa (eye worm) hypothetical protein 0.0043 0.1242 0.1387
Schistosoma mansoni hypothetical protein 0.0025 0.0548 0.0466
Loa Loa (eye worm) hypothetical protein 0.0138 0.4783 0.5517
Brugia malayi N-terminal motif family protein 0.0193 0.6837 0.7868
Mycobacterium ulcerans polyketide synthase 0.0027 0.0623 0.3801
Onchocerca volvulus 0.0043 0.1242 0.1168
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0026 0.0603 0.0546
Loa Loa (eye worm) hypothetical protein 0.0156 0.545 0.6295
Mycobacterium tuberculosis Conserved protein 0.0043 0.1242 0.1242
Loa Loa (eye worm) hypothetical protein 0.0043 0.1242 0.1387
Brugia malayi Carboxylesterase family protein 0.0026 0.0603 0.0443
Loa Loa (eye worm) hypothetical protein 0.0202 0.7174 0.8305
Onchocerca volvulus 0.0026 0.0603 0.0159
Loa Loa (eye worm) bromodomain containing protein 0.0021 0.0414 0.0422
Mycobacterium tuberculosis Carboxylesterase LipT 0.0026 0.0603 0.0603
Loa Loa (eye worm) fatty acid synthase 0.0025 0.0552 0.0582
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0025 0.0564 0.0564
Mycobacterium ulcerans Type I modular polyketide synthase 0.0025 0.0564 0.3212
Brugia malayi RNA recognition motif domain containing protein 0.0199 0.7038 0.8108
Schistosoma mansoni tar DNA-binding protein 0.0199 0.7038 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0016 0.0231 0.0208
Loa Loa (eye worm) hypothetical protein 0.0026 0.0603 0.0642
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.1242 1
Schistosoma mansoni hypothetical protein 0.0064 0.2008 0.2611
Echinococcus granulosus lipoxygenase domain containing protein 0.0024 0.0507 0.0406
Loa Loa (eye worm) carboxylesterase 0.0026 0.0603 0.0642
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0502 0.0323
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.0025 0.0535 0.0535
Echinococcus multilocularis acetylcholinesterase 0.0156 0.545 0.7667
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.1242 0.1486
Loa Loa (eye worm) hypothetical protein 0.0049 0.1456 0.1637
Mycobacterium tuberculosis Polyketide synthase Pks2 0.0025 0.0535 0.0535
Schistosoma mansoni hypothetical protein 0.0064 0.2008 0.2611
Plasmodium vivax hypothetical protein, conserved 0.0043 0.1242 1
Echinococcus granulosus fetal alzheimer antigen falz 0.0027 0.0635 0.0593
Mycobacterium leprae Polyketide synthase Pks13 0.0038 0.1033 0.7902
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.1242 1
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.0021 0.0392 0.0392
Loa Loa (eye worm) latrophilin receptor protein 2 0.0064 0.2008 0.2281
Loa Loa (eye worm) hypothetical protein 0.0085 0.2809 0.3215
Brugia malayi PHD-finger family protein 0.003 0.0741 0.0608
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.1242 1
Brugia malayi Carboxylesterase family protein 0.0156 0.545 0.6217
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.1242 1
Onchocerca volvulus 0.0026 0.0603 0.0159
Loa Loa (eye worm) hypothetical protein 0.0046 0.1349 0.1512
Onchocerca volvulus 0.0043 0.1242 0.1168

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.122 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) = 3.9811 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of 15-hLO (15-human lipoxygenase). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 14.1254 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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